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Docker image with demonstration software stack for AiiDAlab

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Docker Stack for AiiDAlab demonstration deployments

This repository contains the Dockerfile used to define the AiiDAlab demonstration deployment.

Docker images are available from Dockerhub via docker pull aiidalab/aiidalab-docker-stack-demo:latest. See aiidalab/aiidalab-docker-stack for a list of available tags.

How to deploy AiiDAlab locally

We recommend to use aiidalab-launch to run this container on a local workstation.

Citation

Users of AiiDAlab are kindly asked to cite the following publication in their own work:

A. V. Yakutovich et al., Comp. Mat. Sci. 188, 110165 (2021). DOI:10.1016/j.commatsci.2020.110165

Acknowledgements

This work is supported by the MARVEL National Centre for Competency in Research funded by the Swiss National Science Foundation, as well as by the MaX European Centre of Excellence funded by the Horizon 2020 EINFRA-5 program, Grant No. 676598.

MARVEL MaX

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Docker image with demonstration software stack for AiiDAlab

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